Functions/Subroutines
subroutine, public	qs_init (qs_env, para_env, root_section, globenv, cp_subsys, kpoint_env, cell, cell_ref, qmmm, qmmm_env_qm, force_env_section, subsys_section, use_motion_section)
	Read the input and the database files for the setup of the QUICKSTEP environment. More...

Detailed Description

History

Merged with the Quickstep MODULE method_specification (17.01.2002,MK)
USE statements cleaned, added (25.09.2002,MK)
Added more LSD structure (01.2003,Joost VandeVondele)
New molecule data types introduced (Sep. 2003,MK)
Cleaning; getting rid of pnode (02.10.2003,MK)
Sub-system setup added (08.10.2003,MK)

Function/Subroutine Documentation

subroutine, public qs_environment::qs_init	(	type(qs_environment_type), pointer	qs_env,
		type(mp_para_env_type), pointer	para_env,
		type(section_vals_type), optional, pointer	root_section,
		type(global_environment_type), optional, pointer	globenv,
		type(cp_subsys_type), optional, pointer	cp_subsys,
		type(kpoint_type), optional, pointer	kpoint_env,
		type(cell_type), optional, pointer	cell,
		type(cell_type), optional, pointer	cell_ref,
		logical, intent(in), optional	qmmm,
		type(qmmm_env_qm_type), optional, pointer	qmmm_env_qm,
		type(section_vals_type), pointer	force_env_section,
		type(section_vals_type), pointer	subsys_section,
		logical, intent(in)	use_motion_section
	)

Read the input and the database files for the setup of the QUICKSTEP environment.

Parameters

Definition at line 235 of file qs_environment.F.

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